Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C8H2F2N2/c9-7-1-5(3-11)6(4-12)2-8(7)10/h1-2H |
---|---|
SMILES | N#Cc1cc(F)c(cc1C#N)F |
InChI Key | KNDUBEZZKOOYMJ-UHFFFAOYSA-N |
Molecular Formula | C8H2F2N2 |
Exact Mass | 164.112 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/KNDUBEZZKOOYMJ-UHFFFAOYSA-N/CHMO0000596 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/KNDUBEZZKOOYMJ-UHFFFAOYSA-N/CHMO0000596 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2025-02-04T13:27:01.480929 |
MetadataModified | 2025-02-04T13:27:01.480937 |
MetadataPublished | 2025-01-08 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
11960962 | PubChem |
J2.689.593F | Nikkaji |
CB72510289 | ChemicalBook |
DTXSID10474793 | EPA CompTox Dashboard |
ZINC000071791098 | ZINC |
36009346 | eMolecules |
17419265 | PubChem: Thomson Pharma |
SCHEMBL2783854 | SureChEMBL |
The data in this table is sourced from UniChem at EBI. |